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Details

Stereochemistry ACHIRAL
Molecular Formula C6H3Br2O4S.Na
Molecular Weight 353.948
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 2,6-DIBROMOPHENOL-4-SULFONATE

SMILES

[Na+].OC1=C(Br)C=C(C=C1Br)S([O-])(=O)=O

InChI

InChIKey=PBAQEHZYPFSMER-UHFFFAOYSA-M
InChI=1S/C6H4Br2O4S.Na/c7-4-1-3(13(10,11)12)2-5(8)6(4)9;/h1-2,9H,(H,10,11,12);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H3Br2O4S
Molecular Weight 330.959
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 07:51:14 GMT 2023
Edited
by admin
on Sat Dec 16 07:51:14 GMT 2023
Record UNII
G46YYP11KX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 2,6-DIBROMOPHENOL-4-SULFONATE
Common Name English
BENZENESULFONIC ACID, 3,5-DIBROMO-4-HYDROXY-, MONOSODIUM SALT
Common Name English
2,6-DIBROMOPHENOL-4-SULFONATE SODIUM
WHO-DD  
Common Name English
1-PHENOL-4-SULFONIC ACID, 2,6-DIBROMO-, SODIUM SALT
Common Name English
BENZENESULFONIC ACID, 3,5-DIBROMO-4-HYDROXY-, SODIUM SALT (1:1)
Common Name English
3,5-DIBROMO-4-HYDROXY-BENZENESULFONIC ACID, MONOSODIUM SALT
Common Name English
3,5-DIBROMO-4-HYDROXYBENZENESULFONIC ACID SODIUM SALT
Common Name English
2,6-dibromophenol-4-sulfonate sodium [WHO-DD]
Common Name English
Code System Code Type Description
PUBCHEM
23672330
Created by admin on Sat Dec 16 07:51:14 GMT 2023 , Edited by admin on Sat Dec 16 07:51:14 GMT 2023
PRIMARY
EVMPD
SUB12677MIG
Created by admin on Sat Dec 16 07:51:14 GMT 2023 , Edited by admin on Sat Dec 16 07:51:14 GMT 2023
PRIMARY
SMS_ID
100000078273
Created by admin on Sat Dec 16 07:51:14 GMT 2023 , Edited by admin on Sat Dec 16 07:51:14 GMT 2023
PRIMARY
FDA UNII
G46YYP11KX
Created by admin on Sat Dec 16 07:51:14 GMT 2023 , Edited by admin on Sat Dec 16 07:51:14 GMT 2023
PRIMARY
CAS
21886-86-2
Created by admin on Sat Dec 16 07:51:14 GMT 2023 , Edited by admin on Sat Dec 16 07:51:14 GMT 2023
PRIMARY
ECHA (EC/EINECS)
244-632-7
Created by admin on Sat Dec 16 07:51:14 GMT 2023 , Edited by admin on Sat Dec 16 07:51:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID70176286
Created by admin on Sat Dec 16 07:51:14 GMT 2023 , Edited by admin on Sat Dec 16 07:51:14 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
SOLVATE->ANHYDROUS
Related Record Type Details
ACTIVE MOIETY